CHEBI:74649 - 2-thio-N6-L-threonylcarbamoyladenine 5'-monophosphate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-thio-N6-L-threonylcarbamoyladenine 5'-monophosphate
ChEBI ID CHEBI:74649
ChEBI ASCII Name 2-thio-N(6)-L-threonylcarbamoyladenine 5'-monophosphate
Definition A nucleotide-amino acid that is the N6-L-threonylcarbamoyl derivative of 2-thioadenine 5'-monophosphate.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H21N6O11PS
Net Charge 0
Average Mass 524.40000
Monoisotopic Mass 524.07266
InChI InChI=1S/C15H21N6O11PS/c1-4(22)6(13(25)26)17-14(27)18-10-7-11(20-15(34)19-10)21(3-16-7)12-9(24)8(23)5(32-12)2-31-33(28,29)30/h3-6,8-9,12,22-24H,2H2,1H3,(H,25,26)(H2,28,29,30)(H3,17,18,19,20,27,34)/t4-,5-,6+,8-,9-,12-/m1/s1
InChIKey JDVRDUWFLLUZRR-UEVOLSNJSA-N
SMILES C[C@@H](O)[C@H](NC(=O)Nc1nc(S)nc2n(cnc12)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O)C(O)=O
ChEBI Ontology
Outgoing 2-thio-N6-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649) has functional parent adenosine 5'-monophosphate (CHEBI:16027)
2-thio-N6-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649) is a L-threonine derivative (CHEBI:84189)
2-thio-N6-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649) is a aryl thiol (CHEBI:82711)
2-thio-N6-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649) is a nucleotide-amino acid (CHEBI:48116)
2-thio-N6-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649) is a ureas (CHEBI:47857)
Incoming 2-thio-N6-L-threonylcarbamoyladenine 5'-monophosphate residue (CHEBI:74648) is substituent group from 2-thio-N6-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649)
Last Modified
07 January 2015